Geometry & MOs

Info

ID:	337737
PubChem CID:	127258360
Reduced:	ON2C13H27 (2)
Stoich.:	AB2C13D27 (2)
Weight, g/mol:	509.455643
ΔH_f, kcal/mol:	-180.67
Dipole, Da:	2.3
IP(EA), eV:	-8.96(1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N,N-dibutyl-2-(octadecanoylamino)butanediamide

Drug info:

PubChemData

Smile

CCCCCCCCNCCCN(CCCNCCCCCCCC)C(=O)CCC(=O)N

DOS

IR

Vibrations